Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[4-(dimethylamino)benzylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK142978
SMILES Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C/c1ccc(cc1)N(C)C)c1nc2c(s1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H21ClN4OS2 MW 505.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN4OS2/c1-30(2)19-11-7-17(8-12-19)15-21-23(16-33-20-13-9-18(27)10-14-20)29-31(25(21)32)26-28-22-5-3-4-6-24(22)34-26/h3-15H,16H2,1-2H3/b21-15+InChIKey
WYYPOXKTIJFXQW-RCCKNPSSSA-NSynonyms
351162-07-7(4E)2(13BENZOTHIAZOL2YL)5(((4CHLOROPHENYL)SULFANYL)METHYL)4(4(DIMETHYLAMINO)BENZYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4E)2(13benzothiazol2yl)5((4chlorophenyl)sulfanylmethyl)4((4(dimethylamino)phenyl)methylidene)pyrazol3one
(4E)2(13BENZOTHIAZOL2YL)5((4CHLOROPHENYL)SULFANYLMETHYL)4((4DIMETHYLAMINOPHENYL)METHYLIDENE)PYRAZOL3ONE
2(13BENZOTHIAZOL2YL)5(((4CHLOROPHENYL)SULFANYL)METHYL)4(4(DIMETHYLAMINO)BENZYLIDENE)24DIHYDRO3HPYRAZOL3ONE
351162077
Clc1ccc(cc1)SCC1=NN(C(=O)C1=Cc1ccc(cc1)N(C)C)c1nc2c(s1)cccc2
CN(C)C1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)CSC5=CC=C(C=C5)Cl
InChI=1SC26H21ClN4OS2c130(2)1911717(81219)152123(16332013918(27)101420)2931(25(21)32)262822534624(22)3426h315H16H212H3b2115+
MFCD01829467
ZINC000008443920
ZINC08443920
ZINC8443920
Check stock
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Check stock on Vitas-MAvailable files
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